4-tert-butyl-N-[3-[2-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[2-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-[2-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-[[2-[(4-chlorophenyl)thio]-1-oxopropyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[2-(4-chlorophenyl)sulfanylpropanoylamino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[2-[(4-chlorophenyl)thio]propanoylamino]phenyl]benzamide Formula: C26H27ClN2O2S MolecularWeight: 467.02278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)C(C)(C)C)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)C(C)(C)C)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H27ClN2O2S/c1-17(32-23-14-12-20(27)13-15-23)24(30)28-21-6-5-7-22(16-21)29-25(31)18-8-10-19(11-9-18)26(2,3)4/h5-17H,1-4H3,(H,28,30)(H,29,31)